Vitas-M small molecule compound

dimethyl 4-[4-(benzyloxy)-3-methoxyphenyl]-1-(4-fluorobenzyl)-1,4-dihydropyridine-3,5-dicarboxylate

Catalog ID
STK404107
SMILES COC(=O)C1=CN(Cc2ccc(cc2)F)C=C(C1c1ccc(c(c1)OC)OCc1ccccc1)C(=O)OC

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C30H28FNO6 MW 517.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FNO6/c1-35-27-15-22(11-14-26(27)38-19-21-7-5-4-6-8-21)28-24(29(33)36-2)17-32(18-25(28)30(34)37-3)16-20-9-12-23(31)13-10-20/h4-15,17-18,28H,16,19H2,1-3H3
InChIKey
XWZXHVVQPAWJRT-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)C2C(=CN(C=C2C(=O)OC)CC3=CC=C(C=C3)F)C(=O)OC)OCC4=CC=CC=C4
DIMETHYL1((4FLUOROPHENYL)METHYL)4(3METHOXY4PHENYLMETHOXYPHENYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(4(benzyloxy)3methoxyphenyl)1(4fluorobenzyl)14dihydropyridine35dicarboxylate
InChI=1SC30H28FNO6c135271522(111426(27)3819217546821)2824(29(33)362)1732(1825(28)30(34)373)162091223(31)131020h415171828H1619H213H3
METHYL1((4FLUOROPHENYL)METHYL)5(METHOXYCARBONYL)4(3METHOXY4(PHENYLMETHOXY)PHENYL)14DIHYDROPYRIDINE3CARBOXYLATE
MFCD04056817
ZINC000001459546
ZINC01459546
ZINC1459546

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.